Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=C(C=C1)C1N(CCC2=C1C(=O)C1=CC=CC=C1C2=O)C(=O)C(Cl)(Cl)Cl

InChIKey

InChIKey=BAHSLHMMTUWKGZ-UHFFFAOYSA-N

Formula

C21H13Cl4NO3

Mass

469.14

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthoquinones

Intermediate Tree Nodes

Not available

Direct Parent

Naphthoquinones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoquinoline quinone - Naphthoquinone - Isoquinolone - Aryl ketone - Quinone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary amine - Ketone - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Alkyl chloride - Amine - Hydrocarbon derivative - Alkyl halide - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as naphthoquinones. These are compounds containing a naphthohydroquinone moiety, which consists of a benzene ring linearly fused to a bezene-1,4-dione (quinone).

External Descriptors

Not available

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